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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	1-((3R,3aR,7R,8aS)-3,6,8,8-Tetramethyl-2,3,4,7,8,8a-hexahydro-1H-3a,7-methanoazulen-5-yl)ethanone
Molecular formula	C17H26O
IUPAC name	1-[(1R,2R,5S,7R)-2,6,6,8-tetramethyl-9-tricyclo[5.3.1.01,5]undec-8-enyl]ethanone
Molecular weight	246.394
Hydrogen bond acceptor	1
Hydrogen bond donor	0
XlogP	4.0
Synonyms	Ethanone, 1-((3R,3aR,7R,8aS)-2,3,4,7,8,8a-hexahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-5-yl)- SCHEMBL1629517 32388-55-9 Acetyl-alpha-cedrene DSSTox_GSID_29353 KB-212288 UNII-X6I62755AK (3R-(3alpha,3abeta,7beta,8aalpha))-1-(2,3,4,7,8,8a-Hexahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-5-yl)ethan-1-one AKOS016009516 EC 251-020-3 NCGC00257473-01 ZINC25722230 1-[[(3R)-2,3,4,7,8,8abeta-Hexahydro-3beta,6,8,8-tetramethyl-1H-3aalpha,7alpha-methanoazulen]-5-yl]ethanone 9-Acetyl-8-cedrene CHEMBL3184309 Ethanone, 1-(2,3,4,7,8,8a-hexahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-5-yl)-, (3R-(3alpha,3abeta,7beta,8aalpha))- Tox21_202194 Acetylcedrene DSSTox_RID_78769 Lixetone Vertofix CAS-32388-55-9 EINECS 251-020-3 NCGC00259743-01 126239-49-4 9-Acetylcedr-8-ene DSSTox_CID_9353 Ethanone, 1-[(3R,3aR,7R,8aS)-2,3,4,7,8,8a-hexahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-5-yl]- Tox21_303481 AJ-82052 DTXSID4029353 NCGC00249184-01 X6I62755AK 1-cedr-8-en-9-ylethanone [ Show all ]
Inchi Key	YBUIAJZFOGJGLJ-SWRJLBSHSA-N
Inchi ID	InChI=1S/C17H26O/c1-10-6-7-15-16(4,5)14-9-17(10,15)8-13(11(14)2)12(3)18/h10,14-15H,6-9H2,1-5H3/t10-,14+,15+,17+/m1/s1
PubChem CID	16220111
ChEMBL	CHEMBL3184309
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
532991	Olfactory receptor 5K1	Q8NHB7	OR5K1	Homo sapiens (Human)	308

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